| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 15th, 2007 | 30 | No |
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 3.62 | 9.79 | -61.61 | 0 | 7 | -1 | 96 | 423.832 | 5 | ↓ |
| Mid Mid (pH 6-8) | 4.06 | 8.91 | -23.29 | 1 | 7 | 0 | 93 | 424.84 | 4 | ↓ |
| Mid Mid (pH 6-8) | 3.03 | 1.69 | -15 | 0 | 7 | 0 | 89 | 424.84 | 5 | ↓ |
